SCHEMBL2408231

SCHEMBL2408231

NC[C@H]1CCN([C@@H]2Cc3ccccc3[C@H]2Oc2ccc([N+](=O)[O-])cc2)C1

nearest known ligand 0.50

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ SLC9A3 P48764 17/20 0.50
▸ TRPC6 Q9Y210 1/20 0.48
▸ CYP2D6 P10635 2/20 0.41
▸ SLC18A3 Q16572 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2411532 1.00 SLC9A3 (0.50) SLC9A3TRPC6CYP2D6SLC18A3
SCHEMBL2411846 0.85 TRPC6 (0.50) SLC9A3TRPC6CYP2D6
SCHEMBL2409218 0.85 TRPC6 (0.50) SLC9A3TRPC6CYP2D6
SCHEMBL12320194 0.85 SLC9A3 (0.50) SLC9A3TRPC6CYP2D6
SCHEMBL2409077 0.85 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL14966575 0.85 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL2410171 0.85 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL14966618 0.85 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL12291653 0.85 TRPC6 (0.52) SLC9A3TRPC6CYP2D6
SCHEMBL2409863 0.85 TRPC6 (0.52) SLC9A3TRPC6CYP2D6

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130131034-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-05-23 — — US claimed
EP-2542524-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-01-09 — — EP claimed
EP-2368876-A1 Derivatives of aminoindanes, their preparation and their application in therapeutics SANOFI (FR) 2011-09-28 — — EP claimed
US-20130131034-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-05-23 — — US disclosed
US-20130131034-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-05-23 — — US disclosed
EP-2542524-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS SANOFI (FR) 2013-01-09 — — EP disclosed
EP-2368876-A1 Derivatives of aminoindanes, their preparation and their application in therapeutics SANOFI (FR) 2011-09-28 — — EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130131034-A1 DERIVATIVES OF AMINOINDANES, THEIR PREPARATION AND THEIR APPLICATION IN THERAPEUTICS ANXA2, ANXA3, ADM2 SLC9A3 1898/4885TRPC6 3080/4885CYP2D6 94/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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